64 Lattice="70.0 0.0 0.0 0.0 70.0 0.0 0.0 0.0 70.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=913.6852918107309 stress="-0.00228242873135877 2.115753530313607e-05 -0.00041196837700464216 2.115753530313607e-05 -0.007476006224227503 -0.002784172702507416 -0.00041196837700464216 -0.002784172702507416 -0.003824889287154809" pbc="F F F" Ni 35.15168962 34.76027973 35.39488292 -7.29127211 -7.14187297 -4.96561088 Ni 36.40025926 35.96345513 36.26425589 -62.25534482 -14.95733049 26.36436798 Ni 37.29080417 36.76338399 35.35563548 42.75132749 38.58279432 -45.54469338 Ni 38.79196985 38.36321670 35.97140285 0.52873046 2.60442141 -0.15323973 Ni 37.56445680 35.22097060 37.19474419 26.69020715 -18.86223544 20.18310417 Ni 38.42316399 36.13491419 39.02820490 -2.06096371 -2.62119324 7.43248950 Ni 35.16645867 36.70261284 37.96229221 -1.16083668 2.64084431 -0.15917520 Ni 36.25785010 38.51159530 39.03174157 -222.50636467 159.64459416 -145.75403641 Ni 39.66553257 34.83586137 34.95003913 -1.05207474 0.46540689 0.41540634 Ni 41.69279145 35.48516653 35.96939539 -3.04158828 -0.31033616 -1.55453407 Ni 42.98859191 36.75349822 34.84996750 2.32220744 2.87549237 -1.61390019 Ni 43.59377992 39.47424229 36.60785777 18.49212491 -25.83210403 -38.74531226 Ni 41.93269970 34.80109158 37.95406319 0.45239013 -0.68086270 5.19964934 Ni 44.15443714 36.30903164 38.71316737 -1.48423271 0.42712946 0.08369389 Ni 39.63289034 37.01298098 37.62512803 4.02895862 0.52275716 -4.45473939 Ni 40.87538761 38.71522179 38.53659014 0.59189517 2.06438091 -5.97221677 Ni 34.92493038 39.70912543 34.91872383 -3.73906832 -3.25608304 -4.98759397 Ni 36.06677261 40.54869564 36.36316804 -11.63204991 -7.39045273 12.73297911 Ni 37.30615210 41.62153918 35.54995189 13.78783348 11.46584671 -8.43218968 Ni 39.04999349 43.42308516 35.65069993 0.68162864 -0.83434735 0.83051994 Ni 37.55630731 39.83963039 37.80053415 4.49173967 0.69451353 0.87915860 Ni 39.32835056 41.23356882 39.31818358 -6.27542310 12.78230424 -13.74385986 Ni 34.55644568 43.09294618 37.26474399 0.96685638 -0.90366168 0.35949092 Ni 36.62780827 44.19139514 39.61508580 -1.49113872 0.48690849 -0.65657447 Ni 40.39694032 40.40777444 35.36232067 -120.94023132 -137.71761693 -94.25796623 Ni 41.11552624 41.22786702 35.92713189 118.24364282 135.56696546 96.86456059 Ni 42.60463178 42.67776218 35.26022837 -0.53455598 -2.05757973 -5.51101875 Ni 43.37593180 43.90214042 36.70740262 1.83583132 3.47499254 5.36857290 Ni 42.97661173 40.29292364 37.84699718 -281.81763739 -498.38994211 -556.91964558 Ni 43.25905976 40.85696437 38.48807910 265.00875648 517.07621793 587.63221636 Ni 40.81358053 42.92214167 37.95767140 347.87357407 -2154.93728714 -854.56060141 Ni 40.70966621 43.56601857 38.21300235 -347.64658158 2153.54814716 854.23816972 Ni 35.11295421 34.97583031 39.35542126 0.66325422 -1.68576849 1.74699215 Ni 36.66975748 36.64786233 41.41251358 -17.34823576 145.83756973 -66.90349926 Ni 37.05415239 37.93399638 39.56341300 220.19995452 -158.39876381 146.01441790 Ni 39.07463206 38.28942230 40.71797828 -31.11203364 -77.51345031 44.62056401 Ni 36.80726603 35.48031851 41.95608291 11.93368648 -147.59632608 61.74650700 Ni 38.12923654 35.88585597 43.42769337 5.35649989 2.32617592 5.47157430 Ni 34.63260389 37.79924689 43.26960620 -22.77975652 -8.57897703 -1.57661999 Ni 36.30231241 38.40111919 43.33849604 21.77851910 5.00768389 3.42329057 Ni 40.86405603 35.63286241 40.34575966 8.81836563 -68.27207174 -78.81564785 Ni 40.74444743 36.56083566 41.40576495 1.72091008 57.30003961 33.68682628 Ni 42.23190345 37.86462278 39.92048672 0.73033966 -4.15506874 0.79008729 Ni 43.65907854 38.91830128 41.15841195 163.12695995 -92.44780652 -160.19954611 Ni 43.32827015 34.88750550 42.23595841 -0.58266548 1.31594341 -0.23474295 Ni 43.80894370 36.81360139 43.98049999 -0.90860065 0.28881062 -1.01722853 Ni 40.38907919 36.94772222 42.93550921 -11.89185818 9.70374210 43.48671438 Ni 41.51437506 38.71249399 43.72829150 0.89137812 1.72879853 1.00294670 Ni 34.86758085 40.76578601 39.84997499 -13.14271961 0.38868303 -4.38296337 Ni 36.68269114 40.73197581 40.43178151 10.10229086 5.47643164 -6.42939085 Ni 38.12498200 42.66819221 40.41125254 -83.65992716 -141.54001353 -62.33086997 Ni 38.71756647 43.68972545 40.87809763 83.22054441 142.32002017 65.73912516 Ni 37.24085097 39.79306404 42.02859866 5.33397406 -3.75218137 6.43391685 Ni 38.91201169 40.69382383 43.40554429 -3.32063410 -2.59584845 3.25721641 Ni 34.70389340 42.69609892 41.74809073 1.24896816 -0.21522678 -0.45515563 Ni 36.58453445 44.08038932 43.99199169 0.32192202 -0.70583059 -1.16595503 Ni 39.56162467 39.46969531 40.05141911 7.99121745 44.87922692 -45.88869378 Ni 40.73089467 40.59697487 40.59061537 30.39577549 15.91745550 12.70750836 Ni 42.66729600 42.06768066 39.90467713 -4.39640152 6.74167161 7.57501553 Ni 43.73816220 43.11925903 41.75199293 -0.46971105 -0.64230594 0.59710551 Ni 42.89326587 39.36752234 41.93186279 -161.03478600 93.46402798 160.17309406 Ni 42.96209652 40.92202399 43.60672418 -0.55937273 1.34278167 0.55701390 Ni 40.37670085 41.72809587 42.36258873 3.62445670 4.44397117 -0.53559973 Ni 40.60577575 43.52167221 43.78293595 -0.07065461 0.58579459 0.30852554